3-[3-[(4-carbamimidoylphenyl)carbonylamino]propanoylamino]-2-(naphthalen-1-ylsulfonylamino)propanoic acid

Systemtic Name: 3-[3-[(4-carbamimidoylphenyl)carbonylamino]propanoylamino]-2-(naphthalen-1-ylsulfonylamino)propanoic acid Openeye Name: 3-[3-[(4-carbamimidoylbenzoyl)amino]propanoylamino]-2-(1-naphthylsulfonylamino)propanoic acid CAS Name: 3-[[3-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-1-oxopropyl]amino]-2-(1-naphthalenylsulfonylamino)propanoic acid IUPAC Name: 3-[3-[(4-carbamimidoylbenzoyl)amino]propanoylamino]-2-(naphthalen-1-ylsulfonylamino)propanoic acid Traditional Name: 3-[3-[(4-amidinobenzoyl)amino]propanoylamino]-2-(1-naphthylsulfonylamino)propionic acid Formula: C24H25N5O6S MolecularWeight: 511.5502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)NC(CNC(=O)CCNC(=O)C3=CC=C(C=C3)C(=N)N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)NC(CNC(=O)CCNC(=O)C3=CC=C(C=C3)C(=N)N)C(=O)O

InChI

InChI=1S/C24H25N5O6S/c25-22(26)16-8-10-17(11-9-16)23(31)27-13-12-21(30)28-14-19(24(32)33)29-36(34,35)20-7-3-5-15-4-1-2-6-18(15)20/h1-11,19,29H,12-14H2,(H3,25,26)(H,27,31)(H,28,30)(H,32,33)